2-Phenyl-1,3-dithiane 2-苯基-1,3-二噻烷
CAS 5425-44-5 MFCD00006656
化学结构图
SMILES: c1ccc(C2SCCCS2)cc1
化学属性
| Mol. Formula | C10H12S2 |
|---|---|
| Mol. Weight | 196.33 |
| Melting Point | 72-74°C |
| Boiling Point | 150 °C at 0.3 mmHg |
别名和识别编码
| Chemical Name | 2-Phenyl-1,3-dithiane |
|---|---|
| MDL Number | MFCD00006656 |
| PubChem Substance ID | 21547 |
| CAS Number | 5425-44-5 |
| EC Number | 226-568-1 |
| Synonym | 2-Phenyl-1,3-dithiane {LY} 2-Phenyl-1,3-dithiane {} {LY} 2-Phenyl-1,3-dithiane {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {} {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {} {} {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {} {} {} {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {} {} {} {} {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {} {} {} {} {} {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-Phenyl-1,3-dithiane {} {} {} {} {} {} {} {} {} {} {} {} {} |
| Chemical Name Translation | 2-苯基-1,3-二噻烷 |
| InChIKey | GXKPARDRBFURON-UHFFFAOYSA-N |
| Beilstein Registry Number | 0130879 |
| LabNetwork Molecule ID | LN02126314 |
| InChI | InChI=1S/C10H12S2/c1-2-5-9(6-3-1)10-11-7-4-8-12-10/h1-3,5-6,10H,4,7-8H2 |
| Canonical SMILES | C1(C2=CC=CC=C2)SCCCS1 |
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分类
- {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Other Heterocyclic Building Blocks, S-Containing
- {SNA} Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Others, S-Containing
- Building Blocks, Chemical Synthesis, Heterocyclic Building Blocks, Others,
相关文献及参考
- 1. Smith, A. B., III; Boldi, A. M. J. Am. Chem. Soc. 119 , 6925, (1997)
- 2. Smith, A. B., III et al. J. Am. Chem. Soc. 125 , 14435, (2003) 摘要
- Beil. 19 ,26
- Corp MSDS 1 (2), 2771:A / FT-NMR 1 (2), 448:B / RegBook 1 (1), 1379:C
- Short: IV/7a Title: Liquid Crystals: One-Ring Systems and Two-Ring Systems without Bridging Groups Author: Vill, V. Editor: Thiem, J. Source: Landolt-Börnstein, New Series Volume: IV/7a Year: 1992 Keyword: organic compounds; enthaly of fusion; melting point; phase transition; liquid crystals; glass transition ISBN: 3-540-55503-X ISBN: 978-3-540-55503-2 Internet Resource: DOI:10.1007/b46098 RefComment: 10 figs., VIII, 268 pages.
安全信息
TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Intraperitoneal SPECIES OBSERVED : Rodent - mouse DOSE/DURATION : 1500 mg/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 19,461,1984
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